oxidanidyl-[4-[[4-[(E)-2-[4-[[4-[oxidanidyl-(4-sulfophenyl)imino-azaniumyl]phenyl]diazenyl]-2-sulfo-phenyl]ethenyl]-3-sulfo-phenyl]diazenyl]phenyl]-(4-sulfophenyl)imino-azanium

Systemtic Name: oxidanidyl-[4-[[4-[(E)-2-[4-[[4-[oxidanidyl-(4-sulfophenyl)imino-azaniumyl]phenyl]diazenyl]-2-sulfo-phenyl]ethenyl]-3-sulfo-phenyl]diazenyl]phenyl]-(4-sulfophenyl)imino-azanium Openeye Name: oxido-[4-[4-[(E)-2-[4-[4-[oxido-(4-sulfophenyl)imino-ammonio]phenyl]azo-2-sulfo-phenyl]vinyl]-3-sulfo-phenyl]azophenyl]-(4-sulfophenyl)imino-ammonium CAS Name: oxido-[4-[4-[(E)-2-[4-[4-[oxido-(4-sulfophenyl)iminoammonio]phenyl]azo-2-sulfophenyl]ethenyl]-3-sulfophenyl]azophenyl]-(4-sulfophenyl)iminoammonium IUPAC Name: oxido-[4-[[4-[(E)-2-[4-[[4-[oxido-(4-sulfophenyl)iminoazaniumyl]phenyl]diazenyl]-2-sulfophenyl]ethenyl]-3-sulfophenyl]diazenyl]phenyl]-(4-sulfophenyl)iminoazanium Traditional Name: oxido-[4-[4-[(E)-2-[4-[4-[oxido-(4-sulfophenyl)imino-ammonio]phenyl]azo-2-sulfo-phenyl]vinyl]-3-sulfo-phenyl]azophenyl]-(4-sulfophenyl)imino-ammonium Formula: C38H28N8O14S4 MolecularWeight: 948.93412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)S(=O)(=O)O)[O-])S(=O)(=O)O)S(=O)(=O)O)[N+](=NC6=CC=C(C=C6)S(=O)(=O)O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)S(=O)(=O)O)[O-])S(=O)(=O)O)S(=O)(=O)O)[N+](=NC6=CC=C(C=C6)S(=O)(=O)O)[O-]

InChI

InChI=1S/C38H28N8O14S4/c47-45(43-29-11-19-35(20-12-29)61(49,50)51)33-15-7-27(8-16-33)39-41-31-5-3-25(37(23-31)63(55,56)57)1-2-26-4-6-32(24-38(26)64(58,59)60)42-40-28-9-17-34(18-10-28)46(48)44-30-13-21-36(22-14-30)62(52,53)54/h1-24H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)/b2-1+,41-39?,42-40?,45-43?,46-44?